3-(4-tert-butylphenoxy)-N-cyclopropylpropanamide

C16H23NO2 — CID 60631425

IUPAC3-(4-tert-butylphenoxy)-N-cyclopropylpropanamide
SMILESCC(C)(C)c1ccc(OCCC(=O)NC2CC2)cc1
InChIInChI=1S/C16H23NO2/c1-16(2,3)12-4-8-14(9-5-12)19-11-10-15(18)17-13-6-7-13/h4-5,8-9,13H,6-7,10-11H2,1-3H3,(H,17,18)
InChIKeyUHUUQWLABOLDAT-UHFFFAOYSA-N
MW261.37 g/mol
LogP3.03
Rot. Bonds5

About 3-(4-tert-butylphenoxy)-N-cyclopropylpropanamide

3-(4-tert-butylphenoxy)-N-cyclopropylpropanamide (PubChem CID 60631425) has the molecular formula C16H23NO2 and a molecular weight of 261.37 g/mol. Its IUPAC name is 3-(4-tert-butylphenoxy)-N-cyclopropylpropanamide.

Molecular Properties

Compound Name3-(4-tert-butylphenoxy)-N-cyclopropylpropanamide
PubChem CID60631425
Molecular FormulaC16H23NO2
Molecular Weight261.37 g/mol
Exact Mass261.17
IUPAC Name3-(4-tert-butylphenoxy)-N-cyclopropylpropanamide
SMILESCC(C)(C)c1ccc(OCCC(=O)NC2CC2)cc1
InChIInChI=1S/C16H23NO2/c1-16(2,3)12-4-8-14(9-5-12)19-11-10-15(18)17-13-6-7-13/h4-5,8-9,13H,6-7,10-11H2,1-3H3,(H,17,18)
InChIKeyUHUUQWLABOLDAT-UHFFFAOYSA-N
XLogP3.03
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(4-tert-butylphenoxy)-N-cyclopropylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclopropyl-3-[4-[(1S)-1-hydroxyethyl]phenoxy]propanamide
CID 55190758
N-cyclohexyl-3-(4-methoxyphenoxy)propanamide
CID 974927
N-(8-azabicyclo[3.2.1]octan-3-yl)-4-(4-tert-butylphenoxy)butanamide
CID 119455929
1-[3-(4-tert-butylphenoxy)propyl]-3-cyclopropylurea
CID 108882913
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-(4-tert-butylphenoxy)butanamide
CID 24590901
3-(4-chlorophenoxy)-N-cyclopentylpropanamide
CID 108790008
3-(4-tert-butylphenoxy)-N-ethylpropanamide
CID 60630698
4-(4-tert-butylphenoxy)-N-[1-(2-cyanoacetyl)piperidin-4-yl]butanamide
CID 108553546
4-[3-[(4-aminocyclohexyl)amino]-3-oxopropoxy]benzamide
CID 119476133
4-(4-tert-butylphenoxy)-N-(1-butylsulfonylpiperidin-4-yl)butanamide
CID 108561153
4-(4-tert-butylphenoxy)-N-[1-[2-oxo-2-(propylamino)ethyl]piperidin-4-yl]butanamide
CID 39146511
3-(4-tert-butylphenoxy)-1-cyclohexylpropan-1-one
CID 39390816

Frequently Asked Questions

What is the IUPAC name of 3-(4-tert-butylphenoxy)-N-cyclopropylpropanamide?
The IUPAC name of 3-(4-tert-butylphenoxy)-N-cyclopropylpropanamide (CID 60631425) is 3-(4-tert-butylphenoxy)-N-cyclopropylpropanamide.
What is the SMILES notation for 3-(4-tert-butylphenoxy)-N-cyclopropylpropanamide?
The canonical SMILES for 3-(4-tert-butylphenoxy)-N-cyclopropylpropanamide is CC(C)(C)c1ccc(OCCC(=O)NC2CC2)cc1.
What is the InChIKey of 3-(4-tert-butylphenoxy)-N-cyclopropylpropanamide?
The InChIKey is UHUUQWLABOLDAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2/c1-16(2,3)12-4-8-14(9-5-12)19-11-10-15(18)17-13-6-7-13/h4-5,8-9,13H,6-7,10-11H2,1-3H3,(H,17,18).
What are the key properties of 3-(4-tert-butylphenoxy)-N-cyclopropylpropanamide?
3-(4-tert-butylphenoxy)-N-cyclopropylpropanamide has a molecular weight of 261.37 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-tert-butylphenoxy)-N-cyclopropylpropanamide is sourced from PubChem (CID 60631425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).